4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione
TL;DR: 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione (CAS 79491-05-7) is a chemical compound with molecular formula C9H9N3O2 and molecular weight 191.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylphenyl)-1,2,4-triazolidine-3,5-dione
Also Known As: p-methyl-4-phenylurazole, 4-(p-Tolyl)-1,2,4-triazolidine-3,5-dione, 4-(4-methylphenyl)-1,2,4-triazolidine-3,5-dione, 1,2,4-Triazolidine-3,5-dione, 4-(4-methylphenyl)-, 4-p-Tolyl-[1,2,4]triazolidin-3,5-dion
| Molecular Formula | C9H9N3O2 |
|---|---|
| Molecular Weight | 191.07 g/mol |
| LogP | 0.16232 |
| Topological Polar Surface Area | 70.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.06947 |
| Heavy Atoms | 14 |
| Complexity | 516.92633 |
Chemical Identifiers
| CAS Number | 79491-05-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)NNC2=O |
Product Overview
4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione (CAS 79491-05-7), with molecular formula C9H9N3O2 and molecular weight 191.07 g/mol. IUPAC: 4-(4-methylphenyl)-1,2,4-triazolidine-3,5-dione.
Chemical Property Profile of 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione
Property Insights of 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione
The XLogP value of 0.16232 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione. The TPSA of 70.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione. Following Lipinski's Rule of Five, 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione?
The CAS number of 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione is 79491-05-7.
What is the molecular formula of 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione?
The molecular formula of 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione is C9H9N3O2.
What is the molecular weight of 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione?
The molecular weight of 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione is 191.07 g/mol.
Where can I buy 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione?
You can request a quote for 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methylphenyl)-1,2,4-triazolidine-3,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.